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MCPA-thioethyl

UUID 2e82e448-c98c-431d-9191-ca4fdc74ee62
Flow Object IDfo-d06eaec999bf560c
Source EF 3.1
Context Environmental → Air → Aircraft cruise height
CAS Numbers 25319-90-8
EC Numbers 246-831-4
prefLabel ⓘ
Language Value Provenance
en MCPA-thioethyl
altLabel ⓘ
Language Value Provenance
en 2-Methyl-4-chlorophenoxymonothioacetic acid <em>S</em>-ethyl ester
en <em>S</em>-Ethyl (4-chloro-2-methylphenoxy)thioacetate
en <em>S</em>-Ethyl-2-methyl-4-chlorophenoxythioacetate
en Acetic acid, [(4-chloro-<em>o</em>-tolyl)oxy]thio-, <em>S</em>-ethyl ester
en Ethanethioic acid, (4-chloro-2-methylphenoxy)-, <em>S</em>-ethyl ester
en Ethanethioic acid, 2-(4-chloro-2-methylphenoxy)-, <em>S</em>-ethyl ester
en Fenothiol
en HOK 7501
en Herbit
en Phenothiol
en Tripion CB
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey AZFKQCNGMSSWDS-UHFFFAOYSA-N
InChI InChI=1S/C11H13ClO2S/c1-3-15-11(13)7-14-10-5-4-9(12)6-8(10)2/h4-6H,3,7H2,1-2H3
IUPAC name 2-(4-chloro-2-methyl-phenoxy)ethanethioic acid S-ethyl ester, 2-(4-chloro-2-methylphenoxy)ethanethioic acid S-ethyl ester, S-ethyl 2-(4-chloranyl-2-methyl-phenoxy)ethanethioate, S-ethyl 2-(4-chloro-2-methyl-phenoxy)ethanethioate, S-ethyl 2-(4-chloro-2-methylphenoxy)ethanethioate
Molecular formula C11H13ClO2S
Molecular mass 244.743
Monoisotopic mass 244.03248
SMILES CCSC(=O)COC1=C(C=C(C=C1)Cl)C, CCSC(=O)COc1ccc(Cl)cc1C

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 2e82e448-c98c-431d-9191-ca4fdc74ee62 s-ethyl (4-chloro-2-methylphenoxy)ethanethioate

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 s-ethyl (4-chloro-2-methylphenoxy)ethanethioate Emissions/Emissions to air/Emissions to lower stratosphere and upper troposphere kg exactMatch —

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 2 — consensus_match group_key=s-ethyl(4-chloro-2-methylphenoxy)ethanethioate||dimension=Environmental > media=Water > water_body=Unknown; cas=25319-90-8; added Common Chemistry CAS names as altLabel: 2-Methyl-4-chlorophenoxymonothioacetic acid <em>S</em>-ethyl ester, <em>S</em>-Ethyl (4-chloro-2-methylphenoxy)thioacetate, <em>S</em>-Ethyl-2-methyl-4-chlorophenoxythioacetate, Acetic acid, [(4-chloro-<em>o</em>-tolyl)oxy]thio-, <em>S</em>-ethyl ester, Ethanethioic acid, (4-chloro-2-methylphenoxy)-, <em>S</em>-ethyl ester, Ethanethioic acid, 2-(4-chloro-2-methylphenoxy)-, <em>S</em>-ethyl ester, Fenothiol, HOK 7501, Herbit, Phenothiol, Tripion CB; object_uuid=fo-d06eaec999bf560c
cas_match_labels 1 — consensus_match group_key=s-ethyl(4-chloro-2-methylphenoxy)ethanethioate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'25319-90-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-d06eaec999bf560c: {'25319-90-8': 'exactMatch'}
prefLabel 1 — consensus_match cas=25319-90-8; cc_chebi_agreed_name='MCPA-thioethyl'; object_uuid=fo-d06eaec999bf560c

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataAircraft cruise height

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': 'S-ethyl (4-chloro-2-methylphenoxy)ethanethioate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': 'MCPA-thioethyl', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25319-90-8'], 'prov:wasDerivedFrom': 'Common Chemistry / ChEBI primary name agreement'}}] cas=25319-90-8; cc_chebi_agreed_name='MCPA-thioethyl'; object_uuid=fo-d06eaec999bf560c
altLabel None [{'@value': 'S-ethyl (4-chloro-2-methylphenoxy)ethanethioate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] cas=25319-90-8; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-d06eaec999bf560c
altLabel [{'@value': 'S-ethyl (4-chloro-2-methylphenoxy)ethanethioate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] [{'@value': '2-Methyl-4-chlorophenoxymonothioacetic acid <em>S</em>-ethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25319-90-8', 'https://commonchemistry.cas.org/detail?cas_rn=25319-90-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>S</em>-Ethyl (4-chloro-2-methylphenoxy)thioacetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25319-90-8', 'https://commonchemistry.cas.org/detail?cas_rn=25319-90-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>S</em>-Ethyl-2-methyl-4-chlorophenoxythioacetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25319-90-8', 'https://commonchemistry.cas.org/detail?cas_rn=25319-90-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Acetic acid, [(4-chloro-<em>o</em>-tolyl)oxy]thio-, <em>S</em>-ethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25319-90-8', 'https://commonchemistry.cas.org/detail?cas_rn=25319-90-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Ethanethioic acid, (4-chloro-2-methylphenoxy)-, <em>S</em>-ethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25319-90-8', 'https://commonchemistry.cas.org/detail?cas_rn=25319-90-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Ethanethioic acid, 2-(4-chloro-2-methylphenoxy)-, <em>S</em>-ethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25319-90-8', 'https://commonchemistry.cas.org/detail?cas_rn=25319-90-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Fenothiol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25319-90-8', 'https://commonchemistry.cas.org/detail?cas_rn=25319-90-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'HOK 7501', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25319-90-8', 'https://commonchemistry.cas.org/detail?cas_rn=25319-90-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Herbit', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25319-90-8', 'https://commonchemistry.cas.org/detail?cas_rn=25319-90-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Phenothiol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25319-90-8', 'https://commonchemistry.cas.org/detail?cas_rn=25319-90-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Tripion CB', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25319-90-8', 'https://commonchemistry.cas.org/detail?cas_rn=25319-90-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=s-ethyl(4-chloro-2-methylphenoxy)ethanethioate||dimension=Environmental > media=Water > water_body=Unknown; cas=25319-90-8; added Common Chemistry CAS names as altLabel: 2-Methyl-4-chlorophenoxymonothioacetic acid <em>S</em>-ethyl ester, <em>S</em>-Ethyl (4-chloro-2-methylphenoxy)thioacetate, <em>S</em>-Ethyl-2-methyl-4-chlorophenoxythioacetate, Acetic acid, [(4-chloro-<em>o</em>-tolyl)oxy]thio-, <em>S</em>-ethyl ester, Ethanethioic acid, (4-chloro-2-methylphenoxy)-, <em>S</em>-ethyl ester, Ethanethioic acid, 2-(4-chloro-2-methylphenoxy)-, <em>S</em>-ethyl ester, Fenothiol, HOK 7501, Herbit, Phenothiol, Tripion CB; object_uuid=fo-d06eaec999bf560c
cas_match_labels None {'25319-90-8': 'exactMatch'} group_key=s-ethyl(4-chloro-2-methylphenoxy)ethanethioate||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'25319-90-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-d06eaec999bf560c: {'25319-90-8': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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